2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride

C12H24ClN3O2 — CID 119590269

IUPAC2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride
SMILESCC(=O)NCC(=O)NC(CN)C1CCCCC1.Cl
InChIInChI=1S/C12H23N3O2.ClH/c1-9(16)14-8-12(17)15-11(7-13)10-5-3-2-4-6-10;/h10-11H,2-8,13H2,1H3,(H,14,16)(H,15,17);1H
InChIKeyHPGZUWWCPJPNEX-UHFFFAOYSA-N
MW277.80 g/mol
LogP0.57
Rot. Bonds5

About 2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride

2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride (PubChem CID 119590269) has the molecular formula C12H24ClN3O2 and a molecular weight of 277.80 g/mol. Its IUPAC name is 2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride
PubChem CID119590269
Molecular FormulaC12H24ClN3O2
Molecular Weight277.80 g/mol
Exact Mass277.16
IUPAC Name2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride
SMILESCC(=O)NCC(=O)NC(CN)C1CCCCC1.Cl
InChIInChI=1S/C12H23N3O2.ClH/c1-9(16)14-8-12(17)15-11(7-13)10-5-3-2-4-6-10;/h10-11H,2-8,13H2,1H3,(H,14,16)(H,15,17);1H
InChIKeyHPGZUWWCPJPNEX-UHFFFAOYSA-N
XLogP0.57
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.80
LogP ≤ 50.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[(2-amino-1-cyclohexylethyl)amino]-2-oxoethyl]-3-cyclopentylpropanamide;hydrochloride
CID 119589621
N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride
CID 119589343
N-[2-[(2-amino-1-cyclopropylethyl)amino]-2-oxoethyl]-3-cyclopentylpropanamide;hydrochloride
CID 119613774
N-(2-amino-1-cyclopentylethyl)-3-methylbutanamide
CID 106737373
N-(2-amino-1-cyclohexylethyl)-2-[(4-chlorophenyl)methylcarbamoylamino]acetamide;hydrochloride
CID 119590150
N-(2-amino-1-cyclopentylethyl)-2-(dimethylamino)acetamide
CID 106737390
N-[2-[(2-amino-1-cyclohexylethyl)amino]-2-oxoethyl]-3-bromobenzamide;hydrochloride
CID 119589813
N-[4-[(2-amino-1-cyclohexylethyl)amino]-4-oxobutan-2-yl]cyclohexanecarboxamide;hydrochloride
CID 119589615
N-(2-amino-1-cyclopentylethyl)-3-cyclohexylpropanamide
CID 106737712
N-(2-amino-1-cyclohexylethyl)-4-(methylamino)butanamide
CID 122080634
N-(2-amino-1-cyclohexylethyl)-2-[methyl(methylsulfonyl)amino]acetamide;hydrochloride
CID 119590776
N-(2-amino-1-cyclohexylethyl)-3-(4-methylphenyl)propanamide;hydrochloride
CID 119589025

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride?
The IUPAC name of 2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride (CID 119590269) is 2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride.
What is the SMILES notation for 2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride?
The canonical SMILES for 2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride is CC(=O)NCC(=O)NC(CN)C1CCCCC1.Cl.
What is the InChIKey of 2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride?
The InChIKey is HPGZUWWCPJPNEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2.ClH/c1-9(16)14-8-12(17)15-11(7-13)10-5-3-2-4-6-10;/h10-11H,2-8,13H2,1H3,(H,14,16)(H,15,17);1H.
What are the key properties of 2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride?
2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride has a molecular weight of 277.80 g/mol, XLogP of 0.57, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride is sourced from PubChem (CID 119590269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).